Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20215244 | 0.92 | MAPT (0.39) | P2RX7MAPTTHRBLMNANOTUM | |
| SCHEMBL20215230 | 0.91 | MAPK14 (0.43) | P2RX7MAPTTHRBSMN1; SMN2NOTUM | |
| SCHEMBL20215257 | 0.91 | CHRM5 (0.46) | P2RX7MAPTSMN1; SMN2NOTUMNR1H2 | |
| SCHEMBL20215219 | 0.91 | P2RX7 (0.41) | P2RX7MAPTLMNANOTUMALDH1A1 | |
| SCHEMBL20215232 | 0.90 | MAPT (0.47) | P2RX7MAPTTHRBLMNANOTUM | |
| SCHEMBL20215246 | 0.89 | PPARG (0.37) | P2RX7NOTUMALDH1A1CHRM5 | |
| SCHEMBL20215256 | 0.87 | KDM4E (0.43) | P2RX7MAPTTHRBLMNASMN1; SMN2 | |
| SCHEMBL20215254 | 0.87 | HCRTR1 (0.41) | P2RX7MAPTNOTUMCHRM5CHRM3 | |
| SCHEMBL20215227 | 0.87 | CYP11B1 (0.39) | NOTUMALDH1A1 | |
| SCHEMBL20215242 | 0.87 | MAPT (0.46) | P2RX7MAPTLMNACHRM5 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9988373-B2 | Nitrogen-containing six-membered cyclic derivatives and pharmaceutical composition comprising the same | SHIONOGI & CO., LTD. (JP) | 2018-06-05 | — | — | US | disclosed |
| US-9988373-B2 | Nitrogen-containing six-membered cyclic derivatives and pharmaceutical composition comprising the same | SHIONOGI & CO., LTD. (JP) | 2018-06-05 | — | — | US | disclosed |